canSAR1605816
FEATURES
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NAMES
    SMILES
    O=C(Cc1cccs1)NCCN1CCOCC1
    InChI
    InChI=1S/C12H18N2O2S/c15-12(10-11-2-1-9-17-11)13-3-4-14-5-7-16-8-6-14/h1-2,9H,3-8,10H2,(H,13,15)
    MOLECULAR FORMULA
    C12H18N2O2S
    CROSS REFERENCES
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    canSAR1605816
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight254.11
    AlogP0.74
    HBond donors1
    HBond acceptors4
    Atoms35
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1605816.